2-[4-[(4-methoxyphenyl)carbonylamino]-2-oxidanylidene-pyrimidin-1-yl]ethyl 4-methoxybenzoate

Systemtic Name: 2-[4-[(4-methoxyphenyl)carbonylamino]-2-oxidanylidene-pyrimidin-1-yl]ethyl 4-methoxybenzoate Openeye Name: 2-[4-[(4-methoxybenzoyl)amino]-2-oxo-pyrimidin-1-yl]ethyl 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid 2-[4-[[(4-methoxyphenyl)-oxomethyl]amino]-2-oxo-1-pyrimidinyl]ethyl ester IUPAC Name: 2-[4-[(4-methoxybenzoyl)amino]-2-oxopyrimidin-1-yl]ethyl 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid 2-[2-keto-4-(p-anisoylamino)pyrimidin-1-yl]ethyl ester Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=NC(=O)N(C=C2)CCOC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=NC(=O)N(C=C2)CCOC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21N3O6/c1-29-17-7-3-15(4-8-17)20(26)23-19-11-12-25(22(28)24-19)13-14-31-21(27)16-5-9-18(30-2)10-6-16/h3-12H,13-14H2,1-2H3,(H,23,24,26,28)